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1,7-Epoxyazulen-7(1H)-ol, octahydro-1-methyl-4-methylene-, (.+-.)-
SpectraBase Compound ID KSf9nkq8kGh
InChI InChI=1S/C12H18O2/c1-8-3-6-12(13)7-10-9(8)4-5-11(10,2)14-12/h9-10,13H,1,3-7H2,2H3/t9-,10+,11-,12+/m1/s1
InChIKey BGVLJDGNTNXOKJ-KXNHARMFSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Erq3tq65MeP
Name 1,7-Epoxyazulen-7(1H)-ol, octahydro-1-methyl-4-methylene-, (.+-.)-
Alternate Name(s) (1.alpha.,3a.beta.,7.alpha.,8a.beta.)-Octahydro-1-methyl-4-methylene-1,7-epoxyazulen-7(1H)-ol (1S,4S,8R,10S)-1-methyl-5-methylene-11-oxatricyclo[6.2.1.0(4,10)]undecan-8-ol
CAS Registry Number 124095-86-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-8-3-6-12(13)7-10-9(8)4-5-11(10,2)14-12/h9-10,13H,1,3-7H2,2H3/t9-,10+,11-,12+/m1/s1
InChIKey BGVLJDGNTNXOKJ-KXNHARMFSA-N
Molecular Weight 194.274 g/mol
SMILES O[C@@]12O[C@]3([C@]([C@](C(=C)CC2)([H])CC3)(C1)[H])C
SPLASH splash10-000x-9700000000-520e1e0b8b5de7c8551c
Source of Spectrum J-55-946-21
Wiley ID 1191154